2-(cyanomethylsulfanyl)-4-ethyl-7,7-dimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-(cyanomethylsulfanyl)-4-ethyl-7,7-dimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-(cyanomethylsulfanyl)-4-ethyl-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-(cyanomethylthio)-4-ethyl-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-(cyanomethylsulfanyl)-4-ethyl-7,7-dimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-(cyanomethylthio)-4-ethyl-5-keto-7,7-dimethyl-1,4,6,8-tetrahydroquinoline-3-carbonitrile Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC2=C1C(=O)CC(C2)(C)C)SCC#N)C#N

Isomeric SMILES

CCC1C(=C(NC2=C1C(=O)CC(C2)(C)C)SCC#N)C#N

InChI

InChI=1S/C16H19N3OS/c1-4-10-11(9-18)15(21-6-5-17)19-12-7-16(2,3)8-13(20)14(10)12/h10,19H,4,6-8H2,1-3H3